CID 6144710

Malon meetco di

Structural Information

Molecular Formula
C11H20N4O2
SMILES
CC/C(=N\NC(=O)CC(=O)N/N=C(\CC)/C)/C
InChI
InChI=1S/C11H20N4O2/c1-5-8(3)12-14-10(16)7-11(17)15-13-9(4)6-2/h5-7H2,1-4H3,(H,14,16)(H,15,17)/b12-8-,13-9-
InChIKey
SKERPTVEPVHJKY-JMVBYTIWSA-N
Compound name
N,N'-bis[(Z)-butan-2-ylideneamino]propanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.15863 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.16591 160.0
[M+Na]+ 263.14785 163.0
[M-H]- 239.15135 162.5
[M+NH4]+ 258.19245 177.4
[M+K]+ 279.12179 163.9
[M+H-H2O]+ 223.15589 152.4
[M+HCOO]- 285.15683 186.4
[M+CH3COO]- 299.17248 208.6
[M+Na-2H]- 261.13330 161.3
[M]+ 240.15808 160.8
[M]- 240.15918 160.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.